Compile Data Set for Download or QSAR

Found 168 hits with Last Name = 'walsh' and Initial = 'da'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuraminidase (Influenza B virus (B/Lee/40))	BDBM4707 (3-(2,2-diaminoimino)-4-methylcarboxamidobenzoate |...) Show SMILES [#6]-[#6](=O)-[#7]-c1ccc(cc1\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O Show InChI InChI=1S/C10H12N4O3/c1-5(15)13-7-3-2-6(9(16)17)4-8(7)14-10(11)12/h2-4H,1H3,(H,13,15)(H,16,17)(H4,11,12,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by ChEMBL					Assay Description In vitro inhibitory activity of the compound against B/Lee/40 Influenza B Neuraminidase.				J Med Chem 42: 2332-43 (1999) Article DOI: 10.1021/jm980707k BindingDB Entry DOI: 10.7270/Q25B01NJ
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (A/Singapore/1/57(H2N2)))	BDBM5266 ((2S,3S,4R)-4-carbamimidamido-2-(dipropylcarbamoyl)...) Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6]-[#6])-[#6](=O)-[#6@H]-1-[#8]-[#6](=[#6]-[#6@@H](\[#7]=[#6](/[#7])-[#7])-[#6@@H]-1-[#7]-[#6](-[#6])=O)-[#6](-[#8])=O |r,c:11| Show InChI InChI=1S/C16H27N5O5/c1-4-6-21(7-5-2)14(23)13-12(19-9(3)22)10(20-16(17)18)8-11(26-13)15(24)25/h8,10,12-13H,4-7H2,1-3H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10-,12+,13+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	6.5	37
University of Alabama at Birmingham					Assay Description A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...				Bioorg Med Chem 7: 2487-97 (1999) Article DOI: 10.1016/s0968-0896(99)00197-2 BindingDB Entry DOI: 10.7270/Q2Z036CV
					More data for this Ligand-Target Pair
Neuraminidase (Influenza B virus (B/Lee/40))	BDBM5265 ((2S,3S,4R)-4-carbamimidamido-3-acetamido-2-[(1R,2S...) Show SMILES [#6]-[#6](=O)-[#7]-[#6@H]-1-[#6@@H](-[#6]=[#6](-[#8]-[#6@@H]-1-[#6@H](-[#8])-[#6@@H](-[#8])-[#6]-[#8])-[#6](-[#8])=O)\[#7]=[#6](/[#7])-[#7] |r,c:6| Show InChI InChI=1S/C12H20N4O7/c1-4(18)15-8-5(16-12(13)14)2-7(11(21)22)23-10(8)9(20)6(19)3-17/h2,5-6,8-10,17,19-20H,3H2,1H3,(H,15,18)(H,21,22)(H4,13,14,16)/t5-,6+,8+,9-,10+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	6.5	37
University of Alabama at Birmingham					Assay Description A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...				Bioorg Med Chem 7: 2487-97 (1999) Article DOI: 10.1016/s0968-0896(99)00197-2 BindingDB Entry DOI: 10.7270/Q2Z036CV
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (A/Singapore/1/57(H2N2)))	BDBM5265 ((2S,3S,4R)-4-carbamimidamido-3-acetamido-2-[(1R,2S...) Show SMILES [#6]-[#6](=O)-[#7]-[#6@H]-1-[#6@@H](-[#6]=[#6](-[#8]-[#6@@H]-1-[#6@H](-[#8])-[#6@@H](-[#8])-[#6]-[#8])-[#6](-[#8])=O)\[#7]=[#6](/[#7])-[#7] |r,c:6| Show InChI InChI=1S/C12H20N4O7/c1-4(18)15-8-5(16-12(13)14)2-7(11(21)22)23-10(8)9(20)6(19)3-17/h2,5-6,8-10,17,19-20H,3H2,1H3,(H,15,18)(H,21,22)(H4,13,14,16)/t5-,6+,8+,9-,10+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	6.5	37
University of Alabama at Birmingham					Assay Description A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...				Bioorg Med Chem 7: 2487-97 (1999) Article DOI: 10.1016/s0968-0896(99)00197-2 BindingDB Entry DOI: 10.7270/Q2Z036CV
					More data for this Ligand-Target Pair
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50017371 (1-[4-(3-{4-[Bis-(4-fluoro-phenyl)-hydroxy-methyl]-...) Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)C(O)(c1ccc(F)cc1)c1ccc(F)cc1)C(C)=O Show InChI InChI=1S/C30H33F2NO4/c1-21(34)22-4-13-28(29(20-22)36-2)37-19-3-16-33-17-14-25(15-18-33)30(35,23-5-9-26(31)10-6-23)24-7-11-27(32)12-8-24/h4-13,20,25,35H,3,14-19H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to histamine H1 receptor in guinea pig cerebral cortex				J Med Chem 32: 105-18 (1989) BindingDB Entry DOI: 10.7270/Q2WM1CD6
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225193 (CHEMBL432463) Show SMILES [Na+].CSc1ccc(cc1)C(=O)c1cc(F)cc(CC([O-])=O)c1N Show InChI InChI=1S/C16H14FNO3S/c1-22-12-4-2-9(3-5-12)16(21)13-8-11(17)6-10(15(13)18)7-14(19)20/h2-6,8H,7,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM76863 (3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-1H-benzim...) Show SMILES O=c1[nH]c2ccccc2n1CCCN1CCN(CC1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C27H30N4O/c32-27-28-24-14-7-8-15-25(24)31(27)17-9-16-29-18-20-30(21-19-29)26(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,26H,9,16-21H2,(H,28,32)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to Histamine H1 receptor in guinea pig cerebral cortex				J Med Chem 32: 105-18 (1989) BindingDB Entry DOI: 10.7270/Q2WM1CD6
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225190 (CHEMBL28508) Show SMILES [Na+].Cc1ccc(cc1)C(=O)c1cc(Cl)cc(CC([O-])=O)c1N Show InChI InChI=1S/C16H14ClNO3/c1-9-2-4-10(5-3-9)16(21)13-8-12(17)6-11(15(13)18)7-14(19)20/h2-6,8H,7,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225114 (CHEMBL28507) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(Cl)cc1C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C15H11BrClNO3/c16-10-3-1-8(2-4-10)15(21)12-7-11(17)5-9(14(12)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225184 (CHEMBL28976) Show SMILES [Na+].CSc1ccc(cc1)C(=O)c1cc(Cl)cc(CC([O-])=O)c1N Show InChI InChI=1S/C16H14ClNO3S/c1-22-12-4-2-9(3-5-12)16(21)13-8-11(17)6-10(15(13)18)7-14(19)20/h2-6,8H,7,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225186 (CHEMBL281012) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(Cl)cc1C(=O)c1ccc(I)cc1 Show InChI InChI=1S/C15H11ClINO3/c16-10-5-9(6-13(19)20)14(18)12(7-10)15(21)8-1-3-11(17)4-2-8/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225122 (CHEMBL29047) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(F)cc1C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C15H11BrFNO3/c16-10-3-1-8(2-4-10)15(21)12-7-11(17)5-9(14(12)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50017374 (1-(4-{3-[4-(Hydroxy-diphenyl-methyl)-piperidin-1-y...) Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)C(O)(c1ccccc1)c1ccccc1)C(C)=O Show InChI InChI=1S/C30H35NO4/c1-23(32)24-14-15-28(29(22-24)34-2)35-21-9-18-31-19-16-27(17-20-31)30(33,25-10-5-3-6-11-25)26-12-7-4-8-13-26/h3-8,10-15,22,27,33H,9,16-21H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to histamine H1 receptor in guinea pig cerebral cortex				J Med Chem 32: 105-18 (1989) BindingDB Entry DOI: 10.7270/Q2WM1CD6
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)	BDBM50078329 (1-[4-CARBOXY-2-(3-PENTYLAMINO)PHENYL]-5,5'-DI(HYDR...) Show SMILES CCC(CC)Nc1cc(ccc1N1C(=O)CCC1(CO)CO)C(O)=O Show InChI InChI=1S/C18H26N2O5/c1-3-13(4-2)19-14-9-12(17(24)25)5-6-15(14)20-16(23)7-8-18(20,10-21)11-22/h5-6,9,13,19,21-22H,3-4,7-8,10-11H2,1-2H3,(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by ChEMBL					Assay Description In vitro inhibitory activity of the compound against H1N9 Influenza A Neuraminidase.				J Med Chem 42: 2332-43 (1999) Article DOI: 10.1021/jm980707k BindingDB Entry DOI: 10.7270/Q25B01NJ
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225136 (CHEMBL538408) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Br)cc1Cl Show InChI InChI=1S/C15H11BrClNO3/c16-9-4-5-10(12(17)7-9)15(21)11-3-1-2-8(14(11)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225141 (CHEMBL418035) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(Cl)cc1C(=O)c1ccc(Br)cc1Cl Show InChI InChI=1S/C15H10BrCl2NO3/c16-8-1-2-10(12(18)5-8)15(22)11-6-9(17)3-7(14(11)19)4-13(20)21/h1-3,5-6H,4,19H2,(H,20,21)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50017372 (4-(3-{4-[Bis-(4-fluoro-phenyl)-hydroxy-methyl]-pip...) Show SMILES COC(=O)c1ccc(OCCCN2CCC(CC2)C(O)(c2ccc(F)cc2)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C29H31F2NO4/c1-35-28(33)21-3-13-27(14-4-21)36-20-2-17-32-18-15-24(16-19-32)29(34,22-5-9-25(30)10-6-22)23-7-11-26(31)12-8-23/h3-14,24,34H,2,15-20H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to histamine H1 receptor in guinea pig cerebral cortex				J Med Chem 32: 105-18 (1989) BindingDB Entry DOI: 10.7270/Q2WM1CD6
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225112 (43-715 | Arthrex | Proquazone) Show SMILES CC(C)n1c2cc(C)ccc2c(nc1=O)-c1ccccc1 Show InChI InChI=1S/C18H18N2O/c1-12(2)20-16-11-13(3)9-10-15(16)17(19-18(20)21)14-7-5-4-6-8-14/h4-12H,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description -Log (Ki) value for butyrylcholinesterase by inhibiting DFP				J Med Chem 27: 1317-21 (1984) BindingDB Entry DOI: 10.7270/Q25T3NPD
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225123 (CHEMBL28543) Show SMILES [Na+].Cc1ccc(cc1)C(=O)c1cc(F)cc(CC([O-])=O)c1N Show InChI InChI=1S/C16H14FNO3/c1-9-2-4-10(5-3-9)16(21)13-8-12(17)6-11(15(13)18)7-14(19)20/h2-6,8H,7,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225195 (CHEMBL31313) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(I)cc1 Show InChI InChI=1S/C15H12INO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225143 (AHR-10282B | Bromday | Bromfenac Sodium | Bromsite...) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C15H12BrNO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225126 (CHEMBL283267) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C21H17NO3/c22-20-17(13-19(23)24)7-4-8-18(20)21(25)16-11-9-15(10-12-16)14-5-2-1-3-6-14/h1-12H,13,22H2,(H,23,24)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (RAT)	BDBM50224285 (AHR-5850D | Amfenac Sodium | CHEBI:75918) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccccc1 Show InChI InChI=1S/C15H13NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h1-8H,9,16H2,(H,17,18)/p-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase				J Med Chem 33: 2296-304 (1990) BindingDB Entry DOI: 10.7270/Q2MS3RR7
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (RAT)	BDBM50225187 (CHEMBL28700) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClNO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase				J Med Chem 33: 2296-304 (1990) BindingDB Entry DOI: 10.7270/Q2MS3RR7
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225118 (CHEMBL436147) Show SMILES [Na+].Cc1ccc(C(=O)c2cccc(CC([O-])=O)c2N)c(C)c1 Show InChI InChI=1S/C17H17NO3/c1-10-6-7-13(11(2)8-10)17(21)14-5-3-4-12(16(14)18)9-15(19)20/h3-8H,9,18H2,1-2H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225121 (CHEMBL286716) Show SMILES [Na+].CSc1ccc(cc1)C(=O)c1cccc(CC([O-])=O)c1N Show InChI InChI=1S/C16H15NO3S/c1-21-12-7-5-10(6-8-12)16(20)13-4-2-3-11(15(13)17)9-14(18)19/h2-8H,9,17H2,1H3,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225134 (CHEMBL32037) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(F)cc1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H11ClFNO3/c16-10-3-1-8(2-4-10)15(21)12-7-11(17)5-9(14(12)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225176 (CHEMBL29291) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(F)cc1C(=O)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C15H10Cl2FNO3/c16-8-1-2-10(12(17)5-8)15(22)11-6-9(18)3-7(14(11)19)4-13(20)21/h1-3,5-6H,4,19H2,(H,20,21)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225181 (CHEMBL282828) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(F)cc1C(=O)c1ccc(F)cc1 Show InChI InChI=1S/C15H11F2NO3/c16-10-3-1-8(2-4-10)15(21)12-7-11(17)5-9(14(12)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225140 (CHEMBL28955) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(F)cc1C(=O)c1ccccc1 Show InChI InChI=1S/C15H12FNO3/c16-11-6-10(7-13(18)19)14(17)12(8-11)15(20)9-4-2-1-3-5-9/h1-6,8H,7,17H2,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225110 (Amfenac | CHEBI:75915) Show SMILES Nc1c(CC(O)=O)cccc1C(=O)c1ccccc1 Show InChI InChI=1S/C15H13NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h1-8H,9,16H2,(H,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description -Log (Ki) value for butyrylcholinesterase by inhibiting DFP				J Med Chem 27: 1317-21 (1984) BindingDB Entry DOI: 10.7270/Q25T3NPD
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50224285 (AHR-5850D | Amfenac Sodium | CHEBI:75918) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccccc1 Show InChI InChI=1S/C15H13NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h1-8H,9,16H2,(H,17,18)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of H-Ras-mediated farnesylation expressed in mouse NIH3T3 cells				J Med Chem 25: 446-51 (1982) BindingDB Entry DOI: 10.7270/Q28P62QH
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50224285 (AHR-5850D | Amfenac Sodium | CHEBI:75918) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccccc1 Show InChI InChI=1S/C15H13NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h1-8H,9,16H2,(H,17,18)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (RAT)	BDBM17638 (2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...) Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1 Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase				J Med Chem 33: 2296-304 (1990) BindingDB Entry DOI: 10.7270/Q2MS3RR7
					More data for this Ligand-Target Pair				3D Structure (crystal)
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50017376 ((+/-)1-(4-tert-butylphenyl)-4-(4-(hydroxydiphenylm...) Show SMILES CC(C)(C)c1ccc(cc1)C(O)CCCN1CCC(CC1)C(O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	295	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to histamine H1 receptor in guinea pig cerebral cortex				J Med Chem 32: 105-18 (1989) BindingDB Entry DOI: 10.7270/Q2WM1CD6
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225187 (CHEMBL28700) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClNO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225135 (CHEMBL284647) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccccc1Cl Show InChI InChI=1S/C15H12ClNO3/c16-12-7-2-1-5-10(12)15(20)11-6-3-4-9(14(11)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225130 (CHEMBL27620) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(Cl)cc1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H11Cl2NO3/c16-10-3-1-8(2-4-10)15(21)12-7-11(17)5-9(14(12)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225117 (CHEMBL28703) Show SMILES [Na+].Cc1ccc(cc1)C(=O)c1cccc(CC([O-])=O)c1N Show InChI InChI=1S/C16H15NO3/c1-10-5-7-11(8-6-10)16(20)13-4-2-3-12(15(13)17)9-14(18)19/h2-8H,9,17H2,1H3,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225185 (CHEMBL28511) Show SMILES [Na+].CSc1ccc(cc1)C(=O)c1cc(C)cc(CC([O-])=O)c1N Show InChI InChI=1S/C17H17NO3S/c1-10-7-12(9-15(19)20)16(18)14(8-10)17(21)11-3-5-13(22-2)6-4-11/h3-8H,9,18H2,1-2H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (RAT)	BDBM50228722 (CHEMBL75896) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)C1CCCCC1 Show InChI InChI=1S/C15H19NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9,16H2,(H,17,18)/p-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase				J Med Chem 33: 2296-304 (1990) BindingDB Entry DOI: 10.7270/Q2MS3RR7
					More data for this Ligand-Target Pair
Neuraminidase (Influenza B virus (B/Lee/40))	BDBM5266 ((2S,3S,4R)-4-carbamimidamido-2-(dipropylcarbamoyl)...) Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6]-[#6])-[#6](=O)-[#6@H]-1-[#8]-[#6](=[#6]-[#6@@H](\[#7]=[#6](/[#7])-[#7])-[#6@@H]-1-[#7]-[#6](-[#6])=O)-[#6](-[#8])=O |r,c:11| Show InChI InChI=1S/C16H27N5O5/c1-4-6-21(7-5-2)14(23)13-12(19-9(3)22)10(20-16(17)18)8-11(26-13)15(24)25/h8,10,12-13H,4-7H2,1-3H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10-,12+,13+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	6.5	37
University of Alabama at Birmingham					Assay Description A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...				Bioorg Med Chem 7: 2487-97 (1999) Article DOI: 10.1016/s0968-0896(99)00197-2 BindingDB Entry DOI: 10.7270/Q2Z036CV
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225120 (CHEMBL28469) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C15H11Cl2NO3/c16-9-4-5-10(12(17)7-9)15(21)11-3-1-2-8(14(11)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225178 (CHEMBL282824) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(Br)cc1C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H11BrClNO3/c16-10-5-9(6-13(19)20)14(18)12(7-10)15(21)8-1-3-11(17)4-2-8/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225191 (CHEMBL284879) Show SMILES [Na+].Cc1cc(CC([O-])=O)c(N)c(c1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C16H14ClNO3/c1-9-6-11(8-14(19)20)15(18)13(7-9)16(21)10-2-4-12(17)5-3-10/h2-7H,8,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225113 (CHEMBL441960) Show SMILES [Na+].Cc1cc(CC([O-])=O)c(N)c(c1)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C16H14BrNO3/c1-9-6-11(8-14(19)20)15(18)13(7-9)16(21)10-2-4-12(17)5-3-10/h2-7H,8,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225139 (CHEMBL29112) Show SMILES [Na+].Nc1c(CC([O-])=O)cc(Br)cc1C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C15H11Br2NO3/c16-10-3-1-8(2-4-10)15(21)12-7-11(17)5-9(14(12)18)6-13(19)20/h1-5,7H,6,18H2,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225137 (CHEMBL283661) Show SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(F)cc1 Show InChI InChI=1S/C15H12FNO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1/2 (Bos taurus)	BDBM50225133 (CHEMBL28309) Show SMILES [Na+].COc1cc(CC([O-])=O)c(N)c(c1)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C16H14BrNO4/c1-22-12-6-10(7-14(19)20)15(18)13(8-12)16(21)9-2-4-11(17)5-3-9/h2-6,8H,7,18H2,1H3,(H,19,20)/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prostaglandin G/H synthase obtained from bovine seminal vesicles.				J Med Chem 27: 1379-88 (1984) BindingDB Entry DOI: 10.7270/Q2222X0V
					More data for this Ligand-Target Pair
Histamine H1 receptor (Cavia porcellus (domestic guinea pig))	BDBM50017373 (4-(3-{4-[Bis-(4-fluoro-phenyl)-hydroxy-methyl]-pip...) Show SMILES CCOC(=O)c1ccc(OCCCN2CCC(CC2)C(O)(c2ccc(F)cc2)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C30H33F2NO4/c1-2-36-29(34)22-4-14-28(15-5-22)37-21-3-18-33-19-16-25(17-20-33)30(35,23-6-10-26(31)11-7-23)24-8-12-27(32)13-9-24/h4-15,25,35H,2-3,16-21H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	956	n/a	n/a	n/a	n/a	n/a	n/a
A.H. Robins Company Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Tritiated [3H]- mepyramine binding to histamine H1 receptor in guinea pig cerebral cortex				J Med Chem 32: 105-18 (1989) BindingDB Entry DOI: 10.7270/Q2WM1CD6
					More data for this Ligand-Target Pair

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